#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rok h SER 424 N 0.00 0.00 0.00 1.61 4.64 -1.98 -1.13 113.55 116.70 2rok h SER 424 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2rok h SER 424 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2rok h SER 424 CO 0.00 0.00 0.24 0.77 -0.87 0.00 0.00 176.83 176.97 2rok h SER 425 N 0.00 0.00 0.00 4.97 4.64 -2.08 -3.10 113.55 117.98 2rok h SER 425 Ca 0.17 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.43 2rok h SER 425 Cb 0.97 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 62.96 2rok h SER 425 CO -0.00 0.00 -0.42 0.61 -0.87 0.00 0.00 176.83 176.15 2rok n GLY 426 N -1.27 0.75 0.00 -0.77 0.00 -0.44 -4.95 105.19 98.50 2rok n GLY 426 Ca -0.01 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.84 2rok n GLY 426 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2rok n SER 427 N 0.10 0.00 -4.07 1.61 3.41 -1.14 -5.00 113.62 108.52 2rok n SER 427 Ca -0.04 -1.00 -0.11 0.00 -0.26 0.00 0.00 58.87 57.47 2rok n SER 427 Cb 0.73 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.60 2rok n SER 427 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2rok s SER 428 N 0.00 0.05 0.00 4.04 1.04 -1.21 -4.99 113.70 112.62 2rok s SER 428 Ca 0.00 -1.16 0.00 0.00 0.48 0.00 0.00 55.95 55.27 2rok s SER 428 Cb 0.00 0.49 0.00 0.00 0.10 0.00 0.00 66.02 66.61 2rok s SER 428 CO 0.00 -1.00 0.00 0.61 0.98 0.00 0.00 173.24 173.83 2rok n GLY 429 N -0.34 0.74 2.21 7.32 0.00 -1.26 -4.94 105.19 108.93 2rok n GLY 429 Ca 0.00 -0.84 -0.01 0.00 0.00 0.00 0.00 46.02 45.16 2rok n GLY 429 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2rok n GLY 430 N 0.00 0.85 3.38 -0.02 0.00 -1.26 -5.18 105.19 102.96 2rok n GLY 430 Ca 0.00 -1.04 -0.32 0.00 0.00 0.00 0.00 46.02 44.65 2rok n GLY 430 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2rok n PRO 431 N -0.43 -0.88 -3.99 1.61 -0.02 -1.26 -5.08 135.00 124.95 2rok n PRO 431 Ca -0.01 -0.22 -0.09 0.00 -2.02 0.00 0.00 63.50 61.15 2rok n PRO 431 Cb 0.33 -1.84 -0.08 0.00 -0.02 0.00 0.00 33.50 31.90 2rok n PRO 431 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2rok s ASP 432 N -2.00 0.14 1.21 2.55 2.15 -1.26 -5.19 116.67 114.27 2rok s ASP 432 Ca 0.58 -0.91 -0.19 0.00 0.43 0.00 0.00 52.55 52.45 2rok s ASP 432 Cb -0.18 0.37 0.29 0.00 -0.30 0.00 0.00 42.92 43.10 2rok s ASP 432 CO 0.66 -0.81 1.11 -0.76 -0.17 0.00 0.00 175.17 175.20 2rok s LEU 433 N -2.96 0.67 -1.14 -1.34 1.43 -1.26 -4.65 118.68 109.42 2rok s LEU 433 Ca 0.16 0.61 -0.14 0.00 -1.03 0.00 0.00 54.13 53.73 2rok s LEU 433 Cb 0.05 -2.33 -0.02 0.00 0.03 0.00 0.00 46.19 43.92 2rok s LEU 433 CO -0.02 -4.16 0.80 0.00 0.23 0.00 0.00 176.35 173.20 2rok n GLN 434 N -4.78 -1.99 -0.96 1.70 1.13 -1.26 -5.02 117.38 106.19 2rok n GLN 434 Ca 0.13 0.58 -0.29 0.00 -1.94 0.00 0.00 57.00 55.48 2rok n GLN 434 Cb 0.60 -4.69 0.18 0.00 0.11 0.00 0.00 30.24 26.43 2rok n GLN 434 CO 0.00 0.00 0.00 -1.25 -1.44 0.00 0.00 177.06 174.37 2rok s PRO 435 N -5.60 0.50 -0.09 -1.09 0.04 -1.26 -5.02 135.00 122.48 2rok s PRO 435 Ca 0.40 0.87 0.16 0.00 0.04 0.00 0.00 61.00 62.47 2rok s PRO 435 Cb -0.12 -1.72 0.35 0.00 0.04 0.00 0.00 34.50 33.05 2rok s PRO 435 CO 0.83 -2.77 1.16 1.17 0.04 0.00 0.00 177.00 177.42 2rok n LYS 436 N -4.26 0.70 0.00 4.56 4.81 -1.26 -4.74 118.16 117.97 2rok n LYS 436 Ca 0.06 -2.37 0.00 0.00 -0.87 0.00 0.00 58.31 55.13 2rok n LYS 436 Cb 0.55 -0.81 0.00 0.00 0.02 0.00 0.00 35.03 34.79 2rok n LYS 436 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 2rok n ARG 437 N -0.37 0.10 0.09 1.64 5.12 -1.26 -4.82 116.66 117.15 2rok n ARG 437 Ca 0.11 -0.57 0.08 0.00 -1.93 0.00 0.00 57.85 55.54 2rok n ARG 437 Cb 0.86 -0.83 0.37 0.00 -1.16 0.00 0.00 32.46 31.71 2rok n ARG 437 CO 0.00 0.00 0.00 -3.47 -1.93 0.00 0.00 177.63 172.23 2rok n ASP 438 N -0.09 0.35 -0.39 0.55 2.03 -1.26 -1.91 116.55 115.82 2rok n ASP 438 Ca 0.00 0.63 0.05 0.00 0.52 0.00 0.00 54.79 55.99 2rok n ASP 438 Cb 0.16 -0.69 0.12 0.00 -0.72 0.00 0.00 41.12 39.99 2rok n ASP 438 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2rok n HIS 439 N -1.93 0.33 -4.38 -0.67 1.44 -1.26 -4.67 115.22 104.08 2rok n HIS 439 Ca 0.01 -0.65 -0.34 0.00 -2.01 0.00 0.00 57.72 54.73 2rok n HIS 439 Cb 0.10 -0.11 -0.14 0.00 0.12 0.00 0.00 29.99 29.96 2rok n HIS 439 CO 0.00 0.00 0.00 0.08 -2.81 0.00 0.00 176.34 173.61 2rok s VAL 440 N -1.64 3.01 0.46 0.61 1.01 -0.80 -1.34 120.40 121.70 2rok s VAL 440 Ca 0.21 -0.65 -0.01 0.00 0.00 0.00 0.00 61.98 61.53 2rok s VAL 440 Cb 0.15 -2.30 -0.00 0.00 0.00 0.00 0.00 36.38 34.22 2rok s VAL 440 CO 0.07 0.49 0.70 -0.76 0.00 0.00 0.00 175.10 175.60 2rok s LEU 441 N 0.88 3.61 -0.06 3.92 1.43 -0.03 -1.70 118.68 126.73 2rok s LEU 441 Ca -0.03 0.37 0.05 0.00 -1.03 0.00 0.00 54.13 53.49 2rok s LEU 441 Cb -0.15 -3.24 -0.01 0.00 0.03 0.00 0.00 46.19 42.82 2rok s LEU 441 CO -0.00 -0.72 -0.22 -2.28 0.23 0.00 0.00 176.35 173.36 2rok s HIS 442 N -2.60 2.16 -0.03 0.29 5.65 0.31 -1.29 115.29 119.77 2rok s HIS 442 Ca 0.49 -0.66 0.03 0.00 0.25 0.00 0.00 55.06 55.17 2rok s HIS 442 Cb -0.10 -1.43 -0.00 0.00 -1.18 0.00 0.00 32.58 29.87 2rok s HIS 442 CO 0.39 -0.22 -0.12 0.08 -0.65 0.00 0.00 174.74 174.22 2rok s VAL 443 N -0.03 1.00 -0.03 0.89 1.01 0.04 -1.43 120.40 121.84 2rok s VAL 443 Ca -0.05 -0.49 0.03 0.00 0.00 0.00 0.00 61.98 61.47 2rok s VAL 443 Cb -0.13 -0.87 0.00 0.00 0.00 0.00 0.00 36.38 35.38 2rok s VAL 443 CO 0.04 0.30 -0.12 -0.89 0.00 0.00 0.00 175.10 174.42 2rok s THR 444 N 0.07 1.05 0.12 3.92 2.01 -0.19 -1.64 115.64 120.99 2rok s THR 444 Ca -0.02 -0.51 -0.23 0.00 0.31 0.00 0.00 61.69 61.24 2rok s THR 444 Cb -0.09 -0.92 0.06 0.00 0.01 0.00 0.00 72.50 71.57 2rok s THR 444 CO 0.01 0.31 0.58 0.72 -0.69 0.00 0.00 174.62 175.55 2rok s PHE 445 N 0.13 -0.50 0.44 4.92 -0.12 -0.51 -0.92 117.98 121.42 2rok s PHE 445 Ca -0.03 0.38 -0.25 0.00 -0.05 0.00 0.00 56.93 56.98 2rok s PHE 445 Cb -0.10 0.49 -0.09 0.00 -0.63 0.00 0.00 43.02 42.69 2rok s PHE 445 CO 0.01 -0.79 1.24 -2.30 -0.05 0.00 0.00 175.22 173.33 2rok n PRO 446 N -0.14 1.81 0.32 1.99 -0.02 -1.26 -4.59 135.00 133.10 2rok n PRO 446 Ca -0.17 0.65 0.20 0.00 -2.02 0.00 0.00 63.50 62.15 2rok n PRO 446 Cb 0.64 -2.35 1.05 0.00 -0.02 0.00 0.00 33.50 32.82 2rok n PRO 446 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 2rok h LYS 447 N 1.92 0.00 0.00 -0.52 2.10 -1.92 -1.95 116.57 116.20 2rok h LYS 447 Ca -0.48 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.17 2rok h LYS 447 Cb 1.30 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.63 2rok h LYS 447 CO 0.59 0.00 -0.01 0.93 -2.00 0.00 0.00 179.45 178.96 2rok h GLU 448 N 0.00 0.00 -7.12 0.07 4.39 -1.90 -3.44 114.58 106.58 2rok h GLU 448 Ca 0.00 0.00 -0.53 0.00 0.34 0.00 0.00 59.36 59.17 2rok h GLU 448 Cb 0.18 0.00 0.13 0.00 -0.10 0.00 0.00 28.75 28.96 2rok h GLU 448 CO 0.00 0.01 0.46 -1.58 -1.16 0.00 0.00 179.01 176.74 2rok s TRP 449 N -4.19 2.28 0.20 4.33 0.52 -0.73 -5.07 118.94 116.27 2rok s TRP 449 Ca -0.04 1.53 0.01 0.00 0.02 0.00 0.00 56.10 57.61 2rok s TRP 449 Cb 0.13 -3.50 -0.05 0.00 -1.15 0.00 0.00 33.47 28.90 2rok s TRP 449 CO 0.46 -2.40 0.07 0.15 0.02 0.00 0.00 176.95 175.26 2rok s LYS 450 N -3.49 1.20 0.39 4.98 1.02 -1.26 -5.05 119.74 117.53 2rok s LYS 450 Ca 0.77 -1.62 0.14 0.00 0.02 0.00 0.00 55.97 55.29 2rok s LYS 450 Cb -0.31 -0.07 0.99 0.00 -0.52 0.00 0.00 37.83 37.92 2rok s LYS 450 CO 0.37 -0.26 1.83 1.15 -0.92 0.00 0.00 175.35 177.52 2rok h THR 451 N 2.60 0.68 -0.48 2.17 2.02 -1.99 -1.42 112.91 116.49 2rok h THR 451 Ca -0.37 -0.17 -0.12 0.00 0.77 0.00 0.00 66.41 66.52 2rok h THR 451 Cb 1.23 0.12 -0.02 0.00 -1.74 0.00 0.00 68.15 67.75 2rok h THR 451 CO 0.59 0.09 -0.17 0.28 0.37 0.00 0.00 175.52 176.68 2rok h SER 452 N 0.51 0.95 0.21 4.18 0.02 -1.99 -0.33 113.55 117.11 2rok h SER 452 Ca 0.51 -0.34 -0.08 0.00 -0.84 0.00 0.00 61.79 61.04 2rok h SER 452 Cb 1.12 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 63.39 2rok h SER 452 CO -0.24 1.11 -0.33 0.44 -1.14 0.00 0.00 176.83 176.67 2rok h ASP 453 N 0.82 0.18 -0.11 3.07 3.32 -1.70 -2.40 116.42 119.60 2rok h ASP 453 Ca 0.12 -0.06 -0.07 0.00 0.02 0.00 0.00 57.03 57.04 2rok h ASP 453 Cb 0.73 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.23 2rok h ASP 453 CO 0.06 0.50 -0.20 -0.07 -1.72 0.00 0.00 179.24 177.81 2rok h LEU 454 N 0.16 0.37 -1.22 1.55 3.38 -1.10 -1.15 115.31 117.31 2rok h LEU 454 Ca 0.02 -0.55 0.07 0.00 0.09 0.00 0.00 57.88 57.51 2rok h LEU 454 Cb 0.66 -0.11 -0.06 0.00 0.09 0.00 0.00 40.66 41.25 2rok h LEU 454 CO 0.05 0.85 0.56 1.88 0.09 0.00 0.00 178.44 181.86 2rok h TYR 455 N -0.09 0.95 -0.29 1.13 0.05 -1.03 -2.26 116.97 115.43 2rok h TYR 455 Ca 0.01 0.02 -0.15 0.00 0.05 0.00 0.00 58.73 58.67 2rok h TYR 455 Cb 0.78 -0.31 -0.01 0.00 1.01 0.00 0.00 36.73 38.20 2rok h TYR 455 CO 0.10 0.49 -0.41 1.96 -1.05 0.00 0.00 178.16 179.25 2rok h GLN 456 N 0.92 0.71 -0.35 4.88 4.20 -1.36 -1.87 115.11 122.23 2rok h GLN 456 Ca 0.37 -0.37 -0.03 0.00 0.06 0.00 0.00 58.65 58.68 2rok h GLN 456 Cb 0.26 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.03 2rok h GLN 456 CO -0.14 0.98 0.07 1.25 -0.67 0.00 0.00 178.83 180.33 2rok h LEU 457 N 0.58 0.48 -2.36 1.46 5.85 -0.65 -3.10 115.31 117.56 2rok h LEU 457 Ca 0.05 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.70 2rok h LEU 457 Cb 0.95 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.85 2rok h LEU 457 CO 0.09 0.49 0.00 0.49 -0.34 0.00 0.00 178.44 179.17 2rok n PHE 458 N -4.34 0.44 0.04 1.25 3.72 -0.92 -4.56 117.46 113.09 2rok n PHE 458 Ca 0.02 -0.30 0.19 0.00 -0.05 0.00 0.00 57.45 57.32 2rok n PHE 458 Cb 0.19 -0.01 0.71 0.00 -0.94 0.00 0.00 39.48 39.43 2rok n PHE 458 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 2rok h SER 459 N 3.33 0.00 0.00 4.37 0.87 -1.26 -1.26 113.55 119.60 2rok h SER 459 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2rok h SER 459 Cb 0.82 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.78 2rok h SER 459 CO 0.00 0.00 0.04 0.00 -0.53 0.00 0.00 176.83 176.34 2rok n ALA 460 N -2.59 0.97 0.02 6.23 0.00 -1.26 -2.15 120.51 121.73 2rok n ALA 460 Ca 0.08 0.12 0.01 0.00 0.00 0.00 0.00 53.44 53.66 2rok n ALA 460 Cb 0.56 -1.13 0.03 0.00 0.00 0.00 0.00 19.45 18.91 2rok n ALA 460 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2rok n PHE 461 N -1.95 0.07 -4.09 0.00 3.72 -0.47 -5.13 117.46 109.61 2rok n PHE 461 Ca -0.01 -0.29 0.00 0.00 -0.05 0.00 0.00 57.45 57.10 2rok n PHE 461 Cb 0.06 -0.03 0.00 0.00 -0.94 0.00 0.00 39.48 38.57 2rok n PHE 461 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2rok n GLY 462 N -0.07 -0.16 3.76 1.37 0.00 -0.91 -4.64 105.19 104.54 2rok n GLY 462 Ca 0.02 -1.04 -0.40 0.00 0.00 0.00 0.00 46.02 44.60 2rok n GLY 462 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2rok n ASN 463 N 1.11 3.33 -3.40 1.61 5.15 -1.26 -4.60 115.26 117.20 2rok n ASN 463 Ca 0.00 1.13 -0.17 0.00 -0.60 0.00 0.00 54.58 54.94 2rok n ASN 463 Cb 0.00 -1.60 -0.07 0.00 -0.53 0.00 0.00 39.78 37.58 2rok n ASN 463 CO 0.00 0.00 0.00 0.27 1.40 0.00 0.00 177.26 178.93 2rok s ILE 464 N -1.19 0.00 0.03 -1.44 -4.36 -1.26 -3.99 121.20 108.98 2rok s ILE 464 Ca 0.61 -1.82 0.04 0.00 -0.26 0.00 0.00 60.65 59.21 2rok s ILE 464 Cb -0.45 -2.55 -0.02 0.00 1.25 0.00 0.00 42.46 40.69 2rok s ILE 464 CO 0.58 0.00 -0.11 -1.58 0.24 0.00 0.00 174.94 174.07 2rok s GLN 465 N -3.36 0.75 -0.06 0.37 0.74 -0.84 -5.01 119.66 112.24 2rok s GLN 465 Ca 0.36 -0.61 0.03 0.00 0.05 0.00 0.00 55.36 55.19 2rok s GLN 465 Cb 0.02 -0.70 0.01 0.00 1.10 0.00 0.00 33.01 33.43 2rok s GLN 465 CO 0.23 0.17 -0.16 0.42 -0.55 0.00 0.00 175.29 175.40 2rok s ILE 466 N -0.75 1.38 -0.33 -2.34 1.01 -1.26 -1.00 121.20 117.90 2rok s ILE 466 Ca -0.00 -0.65 -0.01 0.00 0.00 0.00 0.00 60.65 59.99 2rok s ILE 466 Cb -0.07 -1.22 0.11 0.00 0.01 0.00 0.00 42.46 41.29 2rok s ILE 466 CO 0.01 0.41 0.15 -0.44 0.00 0.00 0.00 174.94 175.06 2rok s SER 467 N 0.39 3.66 0.63 3.58 0.01 -0.25 -5.02 113.70 116.70 2rok s SER 467 Ca -0.12 -1.83 -0.18 0.00 1.31 0.00 0.00 55.95 55.14 2rok s SER 467 Cb -0.15 -0.69 -0.03 0.00 0.21 0.00 0.00 66.02 65.37 2rok s SER 467 CO 0.04 -0.38 1.12 0.79 0.41 0.00 0.00 173.24 175.22 2rok n TRP 468 N 4.57 1.33 0.00 2.43 7.02 -1.26 -0.73 117.44 130.80 2rok n TRP 468 Ca 0.01 0.42 0.00 0.00 -1.02 0.00 0.00 57.50 56.92 2rok n TRP 468 Cb 0.40 -2.20 0.00 0.00 -2.42 0.00 0.00 31.31 27.09 2rok n TRP 468 CO 0.00 0.00 0.00 0.44 -2.02 0.00 0.00 177.69 176.11 2rok n ILE 469 N -1.87 0.00 -3.99 -0.99 -5.35 -0.98 -4.83 119.36 101.34 2rok n ILE 469 Ca 0.15 -0.01 -0.09 0.00 -0.27 0.00 0.00 62.75 62.52 2rok n ILE 469 Cb 0.48 0.24 -0.05 0.00 -1.74 0.00 0.00 39.64 38.57 2rok n ILE 469 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 2rok s ASP 470 N -0.65 -0.02 0.49 7.28 2.15 -0.63 -4.98 116.67 120.30 2rok s ASP 470 Ca 0.00 -0.97 0.33 0.00 0.43 0.00 0.00 52.55 52.35 2rok s ASP 470 Cb 0.00 0.60 1.75 0.00 -0.30 0.00 0.00 42.92 44.97 2rok s ASP 470 CO 0.00 -1.18 2.01 -0.78 -0.17 0.00 0.00 175.17 175.06 2rok h ASP 471 N 2.23 0.00 0.00 -0.34 3.58 -2.00 -3.20 116.42 116.69 2rok h ASP 471 Ca -0.26 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.19 2rok h ASP 471 Cb 1.25 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.30 2rok h ASP 471 CO 0.35 0.00 0.00 0.35 -2.88 0.00 0.00 179.24 177.06 2rok n THR 472 N -2.69 0.20 -3.61 2.25 -2.24 -1.26 -4.34 114.28 102.59 2rok n THR 472 Ca -0.02 -0.35 -0.12 0.00 -2.27 0.00 0.00 64.05 61.29 2rok n THR 472 Cb 0.08 1.19 -0.05 0.00 -2.10 0.00 0.00 70.33 69.46 2rok n THR 472 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2rok s SER 473 N -0.20 -0.33 0.16 3.42 1.04 -1.21 -1.43 113.70 115.15 2rok s SER 473 Ca 0.00 -0.07 -0.15 0.00 0.48 0.00 0.00 55.95 56.21 2rok s SER 473 Cb 0.00 0.47 0.02 0.00 0.10 0.00 0.00 66.02 66.61 2rok s SER 473 CO 0.00 -0.77 0.41 0.00 0.98 0.00 0.00 173.24 173.86 2rok s ALA 474 N -3.06 -0.68 0.12 5.32 0.00 -0.65 -1.60 121.76 121.21 2rok s ALA 474 Ca -0.02 -0.35 -0.01 0.00 0.00 0.00 0.00 51.96 51.58 2rok s ALA 474 Cb 0.00 0.79 -0.04 0.00 0.00 0.00 0.00 23.12 23.86 2rok s ALA 474 CO -0.07 -0.70 0.29 -0.06 0.00 0.00 0.00 175.76 175.22 2rok s PHE 475 N -3.87 3.50 -0.07 0.00 0.08 0.09 -0.78 117.98 116.92 2rok s PHE 475 Ca 0.09 0.33 -0.03 0.00 0.12 0.00 0.00 56.93 57.45 2rok s PHE 475 Cb 0.01 -1.83 0.04 0.00 -0.57 0.00 0.00 43.02 40.67 2rok s PHE 475 CO -0.05 0.50 0.06 0.08 -0.10 0.00 0.00 175.22 175.71 2rok s VAL 476 N -1.64 -0.03 -0.32 -0.44 1.01 -0.41 -1.09 120.40 117.48 2rok s VAL 476 Ca 0.37 0.26 -0.26 0.00 0.00 0.00 0.00 61.98 62.34 2rok s VAL 476 Cb -0.12 -0.30 0.01 0.00 0.00 0.00 0.00 36.38 35.97 2rok s VAL 476 CO 0.27 0.09 0.94 -0.44 0.00 0.00 0.00 175.10 175.97 2rok s SER 477 N 2.13 6.79 0.52 3.32 0.01 -0.17 -0.86 113.70 125.44 2rok s SER 477 Ca 0.04 0.82 -0.06 0.00 1.31 0.00 0.00 55.95 58.06 2rok s SER 477 Cb -0.13 -2.48 -0.03 0.00 0.21 0.00 0.00 66.02 63.59 2rok s SER 477 CO -0.05 -0.78 0.85 -0.76 0.41 0.00 0.00 173.24 172.91 2rok s LEU 478 N 3.37 3.51 0.51 2.44 1.43 -0.45 -2.00 118.68 127.49 2rok s LEU 478 Ca 0.39 1.02 0.30 0.00 -1.03 0.00 0.00 54.13 54.81 2rok s LEU 478 Cb -0.13 -3.98 1.07 0.00 0.03 0.00 0.00 46.19 43.19 2rok s LEU 478 CO 0.15 -0.68 1.87 0.77 0.23 0.00 0.00 176.35 178.69 2rok h SER 479 N 0.07 0.00 -4.88 2.29 4.64 -1.82 -3.45 113.55 110.41 2rok h SER 479 Ca -0.46 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 60.70 2rok h SER 479 Cb 1.21 0.00 -0.21 0.00 -0.31 0.00 0.00 62.40 63.08 2rok h SER 479 CO 0.62 0.00 -0.60 -1.10 -0.87 0.00 0.00 176.83 174.88 2rok s GLN 480 N -3.53 0.37 0.46 4.77 -0.21 -1.26 -5.07 119.66 115.20 2rok s GLN 480 Ca 0.03 -0.46 0.25 0.00 0.02 0.00 0.00 55.36 55.21 2rok s GLN 480 Cb 0.08 0.14 1.05 0.00 1.00 0.00 0.00 33.01 35.28 2rok s GLN 480 CO 0.58 -0.08 1.88 -1.00 -2.12 0.00 0.00 175.29 174.55 2rok h PRO 481 N 4.60 0.00 -0.00 2.91 0.13 -1.86 -2.97 132.00 134.80 2rok h PRO 481 Ca -0.31 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.78 2rok h PRO 481 Cb 1.20 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.33 2rok h PRO 481 CO 0.41 0.19 -0.18 0.93 -0.23 0.00 0.00 178.00 179.12 2rok h GLU 482 N 0.00 0.01 0.00 0.86 4.39 -1.98 -2.90 114.58 114.96 2rok h GLU 482 Ca -0.00 -0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.65 2rok h GLU 482 Cb 0.66 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.30 2rok h GLU 482 CO 0.02 0.19 -0.21 1.96 -1.16 0.00 0.00 179.01 179.81 2rok h GLN 483 N 0.01 0.00 -0.27 2.33 4.20 -1.93 -3.13 115.11 116.31 2rok h GLN 483 Ca -0.00 0.00 0.01 0.00 0.06 0.00 0.00 58.65 58.72 2rok h GLN 483 Cb 0.32 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.09 2rok h GLN 483 CO 0.02 0.21 0.17 0.28 -0.67 0.00 0.00 178.83 178.84 2rok h VAL 484 N 0.00 1.05 -0.69 -0.54 2.07 -1.67 -1.66 116.25 114.81 2rok h VAL 484 Ca -0.00 -0.12 -0.03 0.00 0.82 0.00 0.00 66.70 67.37 2rok h VAL 484 Cb 0.64 0.68 -0.03 0.00 -1.52 0.00 0.00 31.29 31.06 2rok h VAL 484 CO 0.03 0.06 0.33 -0.61 0.02 0.00 0.00 177.57 177.40 2rok h GLN 485 N 0.34 0.99 0.43 1.57 5.75 -1.71 -1.31 115.11 121.17 2rok h GLN 485 Ca 0.10 -0.14 -0.02 0.00 -0.15 0.00 0.00 58.65 58.44 2rok h GLN 485 Cb -0.02 -0.18 0.00 0.00 1.07 0.00 0.00 27.48 28.35 2rok h GLN 485 CO -0.03 0.77 -0.21 0.82 -2.65 0.00 0.00 178.83 177.53 2rok h ILE 486 N 0.98 0.57 -0.57 2.39 2.04 -1.54 -1.50 117.51 119.88 2rok h ILE 486 Ca 0.24 -0.18 -0.04 0.00 1.00 0.00 0.00 64.86 65.88 2rok h ILE 486 Cb 0.11 0.66 -0.03 0.00 -0.74 0.00 0.00 36.82 36.82 2rok h ILE 486 CO -0.03 0.03 0.18 0.00 0.00 0.00 0.00 178.15 178.33 2rok h ALA 487 N -0.15 1.24 -0.38 1.87 0.00 -1.15 -1.14 119.26 119.55 2rok h ALA 487 Ca -0.06 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.64 2rok h ALA 487 Cb 0.50 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 2rok h ALA 487 CO 0.10 0.54 0.13 0.28 0.00 0.00 0.00 179.25 180.29 2rok h VAL 488 N 0.84 1.21 -0.37 0.00 2.07 -1.24 -2.72 116.25 116.03 2rok h VAL 488 Ca 0.19 -0.67 -0.01 0.00 0.82 0.00 0.00 66.70 67.04 2rok h VAL 488 Cb 0.24 0.93 -0.02 0.00 -1.52 0.00 0.00 31.29 30.93 2rok h VAL 488 CO -0.01 0.23 0.20 -1.13 0.02 0.00 0.00 177.57 176.88 2rok h ASN 489 N 0.46 0.46 0.88 0.57 -1.24 -0.77 -3.07 115.58 112.87 2rok h ASN 489 Ca 0.12 -0.09 -0.03 0.00 0.71 0.00 0.00 56.30 57.01 2rok h ASN 489 Cb 0.24 -0.12 -0.00 0.00 0.73 0.00 0.00 38.32 39.16 2rok h ASN 489 CO -0.01 0.42 -0.14 0.71 -1.29 0.00 0.00 177.43 177.13 2rok h THR 490 N 0.46 0.38 -0.01 -3.57 1.35 -1.24 -3.17 112.91 107.12 2rok h THR 490 Ca 0.13 -0.85 0.00 0.00 -0.55 0.00 0.00 66.41 65.14 2rok h THR 490 Cb 0.07 1.63 0.00 0.00 -1.73 0.00 0.00 68.15 68.12 2rok h THR 490 CO -0.02 0.14 -0.33 -1.20 -0.25 0.00 0.00 175.52 173.86 2rok n SER 491 N -3.32 0.84 0.22 5.36 7.64 -1.03 -4.06 113.62 119.27 2rok n SER 491 Ca -0.00 -0.68 0.12 0.00 1.01 0.00 0.00 58.87 59.32 2rok n SER 491 Cb 0.36 0.16 0.65 0.00 -1.01 0.00 0.00 64.21 64.38 2rok n SER 491 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 2rok h LYS 492 N 0.81 0.00 0.00 1.43 1.57 -1.56 -2.74 116.57 116.08 2rok h LYS 492 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2rok h LYS 492 Cb 0.50 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.81 2rok h LYS 492 CO 0.00 0.00 0.00 0.66 -0.57 0.00 0.00 179.45 179.54 2rok n TYR 493 N -2.41 0.00 -1.39 -1.35 4.01 -1.26 -5.09 117.16 109.68 2rok n TYR 493 Ca -0.02 -0.34 -0.33 0.00 -0.16 0.00 0.00 57.90 57.06 2rok n TYR 493 Cb 0.18 -0.03 0.09 0.00 -0.31 0.00 0.00 39.34 39.27 2rok n TYR 493 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2rok s ALA 494 N -0.67 2.14 0.00 -0.72 0.00 -1.03 -5.01 121.76 116.47 2rok s ALA 494 Ca 0.00 0.65 0.00 0.00 0.00 0.00 0.00 51.96 52.61 2rok s ALA 494 Cb 0.00 -3.39 0.00 0.00 0.00 0.00 0.00 23.12 19.73 2rok s ALA 494 CO 0.00 -1.82 0.07 0.39 0.00 0.00 0.00 175.76 174.40 2rok n GLU 495 N -2.98 1.92 0.00 0.00 1.02 -1.26 -4.83 120.64 114.51 2rok n GLU 495 Ca 0.12 -0.07 0.00 0.00 -0.02 0.00 0.00 57.16 57.18 2rok n GLU 495 Cb 0.51 -0.38 0.00 0.00 -0.02 0.00 0.00 31.44 31.55 2rok n GLU 495 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 2rok n SER 496 N -0.29 0.45 -3.45 1.62 7.64 -1.26 -5.10 113.62 113.23 2rok n SER 496 Ca 0.00 -1.07 -0.06 0.00 1.01 0.00 0.00 58.87 58.75 2rok n SER 496 Cb 0.05 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.25 2rok n SER 496 CO 0.00 0.00 0.00 -0.72 -3.01 0.00 0.00 175.04 171.31 2rok s TYR 497 N -0.07 -0.03 -0.02 1.43 1.13 -1.26 -4.39 117.35 114.14 2rok s TYR 497 Ca 0.00 -0.45 -0.11 0.00 -1.41 0.00 0.00 57.07 55.09 2rok s TYR 497 Cb 0.00 0.73 0.02 0.00 -1.10 0.00 0.00 41.96 41.61 2rok s TYR 497 CO 0.00 -1.19 0.25 0.50 -2.51 0.00 0.00 175.55 172.59 2rok s ARG 498 N -2.95 0.55 0.03 -3.49 3.52 -0.10 -4.72 118.95 111.78 2rok s ARG 498 Ca 0.15 -0.16 0.04 0.00 -0.13 0.00 0.00 55.73 55.62 2rok s ARG 498 Cb -0.04 0.24 -0.02 0.00 -1.56 0.00 0.00 34.95 33.57 2rok s ARG 498 CO 0.07 -0.14 -0.12 0.42 -0.81 0.00 0.00 175.30 174.73 2rok s ILE 499 N -1.09 0.93 0.24 4.11 1.01 -1.26 -1.02 121.20 124.11 2rok s ILE 499 Ca -0.12 -0.86 -0.08 0.00 0.00 0.00 0.00 60.65 59.60 2rok s ILE 499 Cb -0.05 -0.85 -0.02 0.00 0.01 0.00 0.00 42.46 41.55 2rok s ILE 499 CO 0.03 -0.01 0.35 0.00 0.00 0.00 0.00 174.94 175.31 2rok s GLN 500 N -0.98 1.44 0.78 2.79 -2.07 -0.52 -4.85 119.66 116.26 2rok s GLN 500 Ca 0.00 -1.43 -0.11 0.00 -1.82 0.00 0.00 55.36 52.01 2rok s GLN 500 Cb -0.07 0.39 0.06 0.00 -1.09 0.00 0.00 33.01 32.30 2rok s GLN 500 CO 0.01 -0.56 1.09 0.95 -1.32 0.00 0.00 175.29 175.45 2rok s THR 501 N -4.01 3.29 0.26 3.63 -4.23 -1.26 -0.53 115.64 112.79 2rok s THR 501 Ca 0.29 0.42 -0.02 0.00 -1.18 0.00 0.00 61.69 61.20 2rok s THR 501 Cb 0.02 -3.09 0.25 0.00 1.34 0.00 0.00 72.50 71.02 2rok s THR 501 CO 0.11 -0.55 1.83 0.22 -0.54 0.00 0.00 174.62 175.69 2rok h TYR 502 N -1.07 1.01 -0.30 3.99 5.03 -1.58 -1.81 116.97 122.24 2rok h TYR 502 Ca -0.46 0.03 -0.15 0.00 2.58 0.00 0.00 58.73 60.73 2rok h TYR 502 Cb 1.25 -0.32 -0.01 0.00 1.55 0.00 0.00 36.73 39.21 2rok h TYR 502 CO 0.51 0.42 -0.43 0.00 -1.32 0.00 0.00 178.16 177.34 2rok h ALA 503 N 1.49 0.68 -0.64 1.82 0.00 -1.89 -2.30 119.26 118.42 2rok h ALA 503 Ca 0.44 -0.46 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 2rok h ALA 503 Cb 0.40 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 2rok h ALA 503 CO -0.25 0.67 0.17 0.93 0.00 0.00 0.00 179.25 180.77 2rok h GLU 504 N 0.61 1.01 -0.12 0.00 4.39 -1.88 -0.54 114.58 118.05 2rok h GLU 504 Ca 0.04 -0.23 0.03 0.00 0.34 0.00 0.00 59.36 59.54 2rok h GLU 504 Cb 0.99 -0.14 -0.03 0.00 -0.10 0.00 0.00 28.75 29.47 2rok h GLU 504 CO 0.09 0.90 -0.09 -0.92 -1.16 0.00 0.00 179.01 177.84 2rok h TYR 505 N 0.93 -0.22 -0.56 4.33 3.20 -1.26 -1.16 116.97 122.24 2rok h TYR 505 Ca 0.20 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.09 2rok h TYR 505 Cb 0.34 0.12 -0.03 0.00 1.54 0.00 0.00 36.73 38.69 2rok h TYR 505 CO 0.02 -0.14 0.36 0.28 -1.64 0.00 0.00 178.16 177.04 2rok h VAL 506 N -0.10 1.15 -0.20 1.81 2.07 -1.26 -2.64 116.25 117.09 2rok h VAL 506 Ca 0.08 -0.31 -0.13 0.00 0.82 0.00 0.00 66.70 67.16 2rok h VAL 506 Cb 0.21 0.35 0.00 0.00 -1.52 0.00 0.00 31.29 30.34 2rok h VAL 506 CO -0.18 0.15 -0.39 1.23 0.02 0.00 0.00 177.57 178.40 2rok h GLY 507 N 0.76 0.67 2.00 2.17 0.00 -0.91 -3.16 103.07 104.60 2rok h GLY 507 Ca 0.20 -0.79 -0.03 0.00 0.00 0.00 0.00 47.33 46.71 2rok h GLY 507 CO -0.04 0.71 -0.15 0.50 0.00 0.00 0.00 176.54 177.56 2rok h LYS 508 N 0.29 0.00 0.00 4.80 1.57 -1.26 -3.05 116.57 118.92 2rok h LYS 508 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 2rok h LYS 508 Cb 0.99 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.30 2rok h LYS 508 CO 0.09 0.15 0.00 1.17 -0.57 0.00 0.00 179.45 180.29 2rok n LYS 509 N -3.33 0.04 -4.34 3.15 4.81 -1.00 -4.87 118.16 112.63 2rok n LYS 509 Ca 0.00 0.28 -0.17 0.00 -0.87 0.00 0.00 58.31 57.55 2rok n LYS 509 Cb 0.38 -1.58 -0.10 0.00 0.02 0.00 0.00 35.03 33.75 2rok n LYS 509 CO 0.00 0.00 0.00 -0.65 1.17 0.00 0.00 177.40 177.92 2rok s GLN 510 N -3.07 1.46 0.00 1.64 -0.21 -1.16 -5.10 119.66 113.22 2rok s GLN 510 Ca 0.07 -1.79 0.00 0.00 0.02 0.00 0.00 55.36 53.65 2rok s GLN 510 Cb 0.10 -0.35 0.00 0.00 1.00 0.00 0.00 33.01 33.75 2rok s GLN 510 CO 0.30 -0.28 0.00 1.17 -2.12 0.00 0.00 175.29 174.36 2rok n LYS 511 N -0.50 2.00 0.00 2.91 3.00 -1.26 -4.99 118.16 119.31 2rok n LYS 511 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 2rok n LYS 511 Cb 0.66 -0.98 0.00 0.00 0.00 0.00 0.00 35.03 34.71 2rok n LYS 511 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2rok n GLY 512 N 3.15 1.27 0.00 3.14 0.00 -1.26 -4.98 105.19 106.50 2rok n GLY 512 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2rok n GLY 512 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2rok n LYS 513 N 0.00 0.47 0.29 1.61 4.81 -1.26 -4.75 118.16 119.34 2rok n LYS 513 Ca 0.00 -0.81 0.19 0.00 -0.87 0.00 0.00 58.31 56.82 2rok n LYS 513 Cb 0.00 -0.95 0.97 0.00 0.02 0.00 0.00 35.03 35.07 2rok n LYS 513 CO 0.00 0.00 0.00 1.96 1.17 0.00 0.00 177.40 180.53 2rok h GLN 514 N 0.00 0.00 0.00 1.64 4.20 -1.99 -1.31 115.11 117.65 2rok h GLN 514 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2rok h GLN 514 Cb 0.24 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.02 2rok h GLN 514 CO 0.00 0.00 0.00 -0.39 -0.67 0.00 0.00 178.83 177.77 2rok h VAL 515 N 0.00 0.00 0.00 -0.54 -1.51 -1.96 -3.35 116.25 108.89 2rok h VAL 515 Ca 0.03 -0.30 0.00 0.00 -1.23 0.00 0.00 66.70 65.20 2rok h VAL 515 Cb 0.36 1.20 0.00 0.00 -2.13 0.00 0.00 31.29 30.72 2rok h VAL 515 CO -0.00 0.00 0.00 1.17 -1.23 0.00 0.00 177.57 177.51 2rok n LYS 516 N -2.85 0.00 0.32 5.19 4.81 -0.58 -4.91 118.16 120.14 2rok n LYS 516 Ca -0.00 -0.07 0.21 0.00 -0.87 0.00 0.00 58.31 57.57 2rok n LYS 516 Cb 0.21 -0.42 1.06 0.00 0.02 0.00 0.00 35.03 35.90 2rok n LYS 516 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 2rok h SER 517 N 0.00 0.00 0.00 3.14 4.64 -1.47 -3.47 113.55 116.39 2rok h SER 517 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2rok h SER 517 Cb 0.59 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.68 2rok h SER 517 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 2rok n GLY 518 N -0.77 -0.96 0.34 -0.77 0.00 -1.26 -5.01 105.19 96.76 2rok n GLY 518 Ca -0.02 -1.04 0.19 0.00 0.00 0.00 0.00 46.02 45.14 2rok n GLY 518 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2rok h PRO 519 N 0.00 0.00 -3.87 1.61 0.11 -1.99 -3.45 132.00 124.42 2rok h PRO 519 Ca 0.00 0.00 -0.13 0.00 0.11 0.00 0.00 66.00 65.98 2rok h PRO 519 Cb 0.00 0.00 -0.09 0.00 0.11 0.00 0.00 31.00 31.02 2rok h PRO 519 CO 0.00 0.00 -0.20 0.45 -0.21 0.00 0.00 178.00 178.04 2rok s SER 520 N -5.19 0.16 0.00 -2.05 0.15 -1.26 -5.10 113.70 100.41 2rok s SER 520 Ca -0.04 -1.12 0.00 0.00 0.70 0.00 0.00 55.95 55.49 2rok s SER 520 Cb 0.13 0.58 0.00 0.00 -1.71 0.00 0.00 66.02 65.01 2rok s SER 520 CO 0.42 -1.14 0.55 -1.20 1.20 0.00 0.00 173.24 173.07 2rok n SER 521 N -0.61 0.89 0.00 5.45 7.64 -1.26 -4.97 113.62 120.76 2rok n SER 521 Ca -0.01 -1.30 0.05 0.00 1.01 0.00 0.00 58.87 58.62 2rok n SER 521 Cb 0.62 0.00 0.29 0.00 -1.01 0.00 0.00 64.21 64.12 2rok n SER 521 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64